5-phenyl-N-[(2R)-2-piperidin-1-ium-1-ylpropyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-phenyl-N-[(2R)-2-piperidin-1-ium-1-ylpropyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-phenyl-N-[(2R)-2-piperidin-1-ium-1-ylpropyl]isoxazole-3-carboxamide CAS Name: 5-phenyl-N-[(2R)-2-(1-piperidin-1-iumyl)propyl]-3-isoxazolecarboxamide IUPAC Name: 5-phenyl-N-[(2R)-2-piperidin-1-ium-1-ylpropyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-phenyl-N-[(2R)-2-piperidin-1-ium-1-ylpropyl]isoxazole-3-carboxamide Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=NOC(=C1)C2=CC=CC=C2)[NH+]3CCCCC3

Isomeric SMILES

C[C@H](CNC(=O)C1=NOC(=C1)C2=CC=CC=C2)[NH+]3CCCCC3

InChI

InChI=1S/C18H23N3O2/c1-14(21-10-6-3-7-11-21)13-19-18(22)16-12-17(23-20-16)15-8-4-2-5-9-15/h2,4-5,8-9,12,14H,3,6-7,10-11,13H2,1H3,(H,19,22)/p+1/t14-/m1/s1